N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1,4-dimethyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C21H26ClN5O2S MolecularWeight: 447.98144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4C)Cl)C

Isomeric SMILES

CC1=CN(N=C1C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4C)Cl)C

InChI

InChI=1S/C21H26ClN5O2S/c1-14-13-25(3)24-18(14)20(28)27(8-4-7-26-9-11-29-12-10-26)21-23-19-15(2)16(22)5-6-17(19)30-21/h5-6,13H,4,7-12H2,1-3H3